| Properties | Image |
| MNX_ID | MNXM150877 |
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| reference | chebi:86453 |
| formula | C18H11BrN2O2 |
| global charge | 0 |
| mol weight | 367.202 |
| InChIKey | SVSYJTYGPLVUOZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C18H11BrN2O2/c19-12-6-7-17(22)14(8-12)16-9-13(11-4-2-1-3-5-11)15(10-20)18(23)21-16/h1-9,22H,(H,21,23) |
| SMILES | N#CC1=C(C2=CC=CC=C2)C=C(C2=C(O)C=CC(Br)=C2)NC1=O |
MNX internals
| InChI (mnx) | InChI=1/C18H11BrN2O2/c19-12-6-7-17(22)14(8-12)16-9-13(11-4-2-1-3-5-11)15(10-20)18(23)21-16/h1-9,22H,(H,21,23) |
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| SMILES (mnx) | [CH:1]1=[CH:2][CH:4]=[C:11]([C:13]2=[CH:9][C:16]([C:14]3=[C:17]([OH:22])[CH:7]=[CH:6][C:12]([Br:19])=[CH:8]3)=[N:21][C:18]([OH:23])=[C:15]2[C:10]#[N:20])[CH:5]=[CH:3]1 |
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